trisodium 4-chloranylphenolate phenoxide

Systemtic Name: trisodium 4-chloranylphenolate phenoxide Openeye Name: trisodium 4-chlorophenolate phenoxide CAS Name: trisodium 4-chlorophenolate phenoxide IUPAC Name: trisodium 4-chlorophenolate phenoxide Traditional Name: trisodium 4-chlorophenolate phenoxide Formula: C12H9ClNa3O2+ MolecularWeight: 289.62097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[O-].C1=CC(=CC=C1[O-])Cl.[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)[O-].C1=CC(=CC=C1[O-])Cl.[Na+].[Na+].[Na+]

InChI

InChI=1S/C6H5ClO.C6H6O.3Na/c7-5-1-3-6(8)4-2-5;7-6-4-2-1-3-5-6;;;/h1-4,8H;1-5,7H;;;/q;;3*+1/p-2